4-[3-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl]benzenecarbonitrile

Systemtic Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl]benzenecarbonitrile Openeye Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl]benzonitrile CAS Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl]benzonitrile IUPAC Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl]benzonitrile Traditional Name: 4-(3-veratryl-1,2,4-oxadiazol-5-yl)benzonitrile Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NOC(=N2)C3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NOC(=N2)C3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C18H15N3O3/c1-22-15-8-5-13(9-16(15)23-2)10-17-20-18(24-21-17)14-6-3-12(11-19)4-7-14/h3-9H,10H2,1-2H3